ChemSpider 2D Image | (2S)-2-[(2R)-2-Ethyl-2-phenyl-1,3-dioxolan-4-yl]piperidine | C16H23NO2

(2S)-2-[(2R)-2-Ethyl-2-phenyl-1,3-dioxolan-4-yl]piperidine

  • Molecular FormulaC16H23NO2
  • Average mass261.359 Da
  • Monoisotopic mass261.172882 Da
  • ChemSpider ID23163744

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2S)-2-[(2R)-2-Ethyl-2-phenyl-1,3-dioxolan-4-yl]piperidin [German] [ACD/IUPAC Name]
(2S)-2-[(2R)-2-Ethyl-2-phenyl-1,3-dioxolan-4-yl]piperidine [ACD/IUPAC Name]
(2S)-2-[(2R)-2-Éthyl-2-phényl-1,3-dioxolan-4-yl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 2-[(2R)-2-ethyl-2-phenyl-1,3-dioxolan-4-yl]-, (2S)- [ACD/Index Name]
2-(2-Ethyl-2-phenyl-[1,3]dioxolan-4-yl)-piperidine
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL307469/

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 373.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.0±3.0 kJ/mol
Flash Point: 157.4±17.3 °C
Index of Refraction: 1.520
Molar Refractivity: 75.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.61
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 3.72
ACD/KOC (pH 7.4): 22.11
Polar Surface Area: 30 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 42.3±3.0 dyne/cm
Molar Volume: 247.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement